Geometry & MOs

Info

ID:	260882
PubChem CID:	103207937
Reduced:	ClNO2F3C13H17 (1)
Stoich.:	ABC2D3E13F17 (1)
Weight, g/mol:	256.176248
ΔH_f, kcal/mol:	-235.21
Dipole, Da:	0.67
IP(EA), eV:	-8.88(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(2-methylpropyl)-2-N-[2-(2,2,2-trifluoroethoxy)ethyl]propane-1,2-diamine

Drug info:

PubChemData

Smile

CCNC(COCC(F)(F)F)C1=C(C=CC(=C1)Cl)OC

DOS

IR

Vibrations